Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GSR | P00390 | 1/20 | 0.59 |
| ▸ | NPC1 | O15118 | 1/20 | 0.45 |
| ▸ | ADAM17 | P78536 | 1/20 | 0.45 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.39 |
| ▸ | MEN1 | O00255 | 4/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.38 |
| ▸ | LMNA | P02545 | 1/20 | 0.38 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.37 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.37 |
| ▸ | GAA | P10253 | 2/20 | 0.37 |
| ▸ | MAPT | P10636 | 1/20 | 0.37 |
| ▸ | ALPG | P10696 | 1/20 | 0.37 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.37 |
| ▸ | NPY1R | P25929 | 1/20 | 0.37 |
| ▸ | HTT | P42858 | 1/20 | 0.37 |
| ▸ | NPY2R | P49146 | 1/20 | 0.37 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.37 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.36 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.36 |
Click a target to see other patent compounds predicted against it — the reverse direction, in place.
Similar compounds — the chemically nearest patent molecules
Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.
| Compound | similarity | top predicted | shared targets | |
|---|---|---|---|---|
| SCHEMBL28350770 | 0.87 | GSR (0.46) | GSRNPC1ADAM17L3MBTL1ALDH1A1 | |
| SCHEMBL28350596 | 0.87 | GSR (0.46) | GSRNPC1ADAM17MEN1KMT2A | |
| SCHEMBL28347265 | 0.87 | GSR (0.46) | GSRNPC1ADAM17ALDH1A1MEN1 | |
| SCHEMBL28350897 | 0.82 | GSR (0.43) | GSRNPC1ADAM17L3MBTL1ALDH1A1 | |
| SCHEMBL28047729 | 0.76 | GSR (0.71) | GSRNPC1ADAM17ALDH1A1MEN1 | |
| SCHEMBL28215784 | 0.75 | GSR (0.69) | GSRNPC1ADAM17ALDH1A1MEN1 | |
| SCHEMBL27319378 | 0.75 | GSR (0.69) | GSRNPC1ADAM17ALDH1A1MEN1 | |
| SCHEMBL9803273 | 0.73 | GSR (0.67) | GSRNPC1ADAM17ALDH1A1KMT2A | |
| SCHEMBL28885399 | 0.72 | GSR (0.65) | GSRNPC1ADAM17ALDH1A1LMNA | |
| SCHEMBL28958827 | 0.72 | GSR (0.65) | GSRNPC1ADAM17ALDH1A1KMT2A |
Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.
Patent provenance — the patents this molecule appears in, and who filed them
Claimed or disclosed in 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-107973819-B | beta-phosphorylated nitrate compound and preparation method thereof | 烟台大学 | 2019-12-17 | — | — | CN | disclosed |